In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 25 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.84 | 9.68 | -42.54 | 1 | 4 | -1 | 69 | 342.39 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.84 | 7.72 | -8.03 | 2 | 4 | 0 | 66 | 343.398 | 4 | ↓ |